N-[1-pentyl-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: N-[1-pentyl-3-(phenylsulfonyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Openeye Name: N-[3-(benzenesulfonyl)-1-pentyl-pyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(benzenesulfonyl)-1-pentyl-2-pyrrolo[3,2-b]quinoxalinyl]benzenesulfonamide IUPAC Name: N-[3-(benzenesulfonyl)-1-pentylpyrrolo[3,2-b]quinoxalin-2-yl]benzenesulfonamide Traditional Name: N-(1-amyl-3-besyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzenesulfonamide Formula: C27H26N4O4S2 MolecularWeight: 534.64974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=CC=C4)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=CC=C4)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O4S2/c1-2-3-12-19-31-26-24(28-22-17-10-11-18-23(22)29-26)25(36(32,33)20-13-6-4-7-14-20)27(31)30-37(34,35)21-15-8-5-9-16-21/h4-11,13-18,30H,2-3,12,19H2,1H3